UCSF

ZINC34379750

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 29 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -2.98 -2.62 -254.16 4 16 -3 256 497.184 8
Mid Mid (pH 6-8) -2.98 -3.77 -138.47 5 16 -2 253 498.192 8

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )